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3,4-Dimethyldiamantane-4-carboxylic acid methyl ester
SpectraBase Compound ID I76DQN3D1EV
InChI InChI=1S/C18H26O2/c1-17-7-13-10-4-9-5-11(13)15(12(6-9)14(10)8-17)18(17,2)16(19)20-3/h9-15H,4-8H2,1-3H3/t9-,10+,11-,12+,13+,14-,15+,17-,18-/m1/s1
InChIKey WHMWELMPLDVFQV-RSXGPXRISA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QGt0u0qEmx
Name 3,4-Dimethyldiamantane-4-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-17-7-13-10-4-9-5-11(13)15(12(6-9)14(10)8-17)18(17,2)16(19)20-3/h9-15H,4-8H2,1-3H3/t9-,10+,11-,12+,13+,14-,15+,17-,18-/m1/s1
InChIKey WHMWELMPLDVFQV-RSXGPXRISA-N
Literature Reference DOI 10.1002/rcm.4977
Molecular Weight 274.404 g/mol
SMILES [C@]12([C@]3([C@@]4([C@@]5(C[C@@](C[C@]2([C@@]5(C[C@]([C@]1(C(=O)OC)C)(C4)C)[H])[H])(C3)[H])[H])[H])[H])[H]
SPLASH splash10-0292-1970000000-5a7fb79f7a0386cf2c51
Source of Spectrum RCM-25-1202-V
Synonyms Methyl (2r,4R,4aS,6s,8R,8ar,10s,11S)-1,2-dimethyldecahydro-2,8,4,6-(epibutane[1,2,3,4]tetrayl)naphthalene-1-carboxylate
Wiley ID 1814829